NCS
中国新化学物质查询
4-[[1-羟基-6-[[[[5-羟基-6-(苯基偶氮)-7-磺基-2-萘基]氨基]羰基]氨基]-3-磺基-2-萘基]偶氮]苯甲酸三钠盐(trisodium 4-[[1-hydroxy-6-[[[[5-hydroxy-6-(phenylazo)-7-sulphonato-2-naphthyl]amino]carbonyl]amino]-3-sulphonato-2-naphthyl]azo]benzoate)
直接橙 6R, abcolorangews, Einecs 229-539-1, C.I. Direct Orange 102
CAS号: 6598-63-6
IUPAC名称: trisodium;4-[[1-hydroxy-6-[(5-hydroxy-6-phenyldiazenyl-7-sulfonatonaphthalen-2-yl)carbamoylamino]-3-sulfonatonaphthalen-2-yl]diazenyl]benzoate
分子式: C34H21N6Na3O11S2
分子量: 822.66300
InChI: InChI=1S/C34H24N6O11S2.3Na/c41-31-25-12-10-23(14-19(25)16-27(52(46,47)48)29(31)39-37-21-4-2-1-3-5-21)35-34(45)36-24-11-13-26-20(15-24)17-28(53(49,50)51)30(32(26)42)40-38-22-8-6-18(7-9-22)33(43)44;;;/h1-17,41-42H,(H,43,44)(H2,35,36,45)(H,46,47,48)(H,49,50,51);;;/q;3*+1/p-3
InChIKey: NEXGZHJENSOMLV-UHFFFAOYSA-K
SMILES: C1=CC=C(C=C1)N=NC2=C(C=C3C=C(C=CC3=C2O)NC(=O)NC4=CC5=CC(=C(C(=C5C=C4)O)N=NC6=CC=C(C=C6)C(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
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